Vitas-M small molecule compound

2-[(1,1-dioxido-1,2-benzothiazol-3-yl)(methyl)amino]ethyl 2,4-dimethoxybenzoate

Catalog ID
STL287677
SMILES COc1cc(OC)ccc1C(=O)OCCN(C1=NS(=O)(=O)c2c1cccc2)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C19H20N2O6S MW 404.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O6S/c1-21(18-15-6-4-5-7-17(15)28(23,24)20-18)10-11-27-19(22)14-9-8-13(25-2)12-16(14)26-3/h4-9,12H,10-11H2,1-3H3
InChIKey
QLWSSSHFGVFIPR-UHFFFAOYSA-N
Synonyms

2((11dioxido12benzothiazol3yl)(methyl)amino)ethyl24dimethoxybenzoate
2((11DIOXO12BENZOTHIAZOL3YL)METHYLAMINO)ETHYL24DIMETHOXYBENZOATE
CN(CCOC(=O)C1=C(C=C(C=C1)OC)OC)C2=NS(=O)(=O)C3=CC=CC=C32
InChI=1SC19H20N2O6Sc121(1815645717(15)28(2324)2018)10112719(22)149813(252)1216(14)263h4912H1011H213H3
MFCD02111495
ZINC000003583420
ZINC3583420

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.